ChemSpider 2D Image | 2-Ethynyl-4,5-dimethyl-1,3-thiazole | C7H7NS

2-Ethynyl-4,5-dimethyl-1,3-thiazole

  • Molecular FormulaC7H7NS
  • Average mass137.202 Da
  • Monoisotopic mass137.029922 Da
  • ChemSpider ID98513686

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Ethinyl-4,5-dimethyl-1,3-thiazol [German] [ACD/IUPAC Name]
2-Ethynyl-4,5-dimethyl-1,3-thiazole [ACD/IUPAC Name]
2-Éthynyl-4,5-diméthyl-1,3-thiazole [French] [ACD/IUPAC Name]
Thiazole, 2-ethynyl-4,5-dimethyl- [ACD/Index Name]
2279122-45-9 [RN]
2-Ethynyl-4,5-dimethylthiazole
MFCD31716751

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 233.8±43.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.1±3.0 kJ/mol
Flash Point: 95.8±18.5 °C
Index of Refraction: 1.550
Molar Refractivity: 39.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 22.01
ACD/KOC (pH 5.5): 318.15
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 22.02
ACD/KOC (pH 7.4): 318.29
Polar Surface Area: 41 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 122.5±5.0 cm3

Click to predict properties on the Chemicalize site


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